9-ethoxy-2-(4-ethylphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
9-ethoxy-2-(4-ethylphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
9-ethoxy-2-(4-ethylphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0168 |
| Compound Name: | 9-ethoxy-2-(4-ethylphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 364.46 |
| Molecular Formula: | C21 H20 N2 O2 S |
| Smiles: | CCc1ccc(cc1)C1NC(C2Cc3cccc(c3OC=2N=1)OCC)=S |
| Stereo: | ACHIRAL |
| logP: | 5.3022 |
| logD: | 5.3022 |
| logSw: | -5.4331 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.529 |
| InChI Key: | HIVJTRVCLZFVBQ-UHFFFAOYSA-N |